Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA9 | Q16790 | 2/20 | 0.38 |
| ▸ | CA12 | O43570 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | PSEN1 | P49768 | 4/20 | 0.37 |
| ▸ | PSEN2 | P49810 | 4/20 | 0.37 |
| ▸ | APH1B | Q8WW43 | 4/20 | 0.37 |
| ▸ | NCSTN | Q92542 | 4/20 | 0.37 |
| ▸ | APH1A | Q96BI3 | 4/20 | 0.37 |
| ▸ | PSENEN | Q9NZ42 | 4/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | MCOLN3 | Q8TDD5 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | CNR2 | P34972 | 3/20 | 0.32 |
| ▸ | CNR1 | P21554 | 2/20 | 0.32 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.32 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.32 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.32 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.31 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.31 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL10794109 | 0.86 | ALDH1A1 (0.35) | CA9PSEN1PSEN2APH1BNCSTN | |
| SCHEMBL10794057 | 0.85 | PSEN1 (0.41) | PSEN1PSEN2APH1BNCSTNAPH1A | |
| SCHEMBL10795633 | 0.82 | NPC1 (0.42) | MAPTALDH1A1CNR2ALOX5 | |
| SCHEMBL10793914 | 0.82 | PSEN1 (0.40) | CA9CA12CA2PSEN1PSEN2 | |
| SCHEMBL10792553 | 0.81 | PSEN1 (0.41) | CA2PSEN1PSEN2APH1BNCSTN | |
| SCHEMBL10794093 | 0.81 | CA12 (0.41) | CA9CA12CA2MAPTALDH1A1 | |
| SCHEMBL10792980 | 0.80 | PSEN1 (0.38) | CA9CA12CA2PSEN1PSEN2 | |
| SCHEMBL10793541 | 0.80 | MAPT (0.47) | CA9CA12CA2MAPTALDH1A1 | |
| SCHEMBL7765528 | 0.78 | ALDH1A1 (0.30) | ALDH1A1 | |
| SCHEMBL4295727 | 0.77 | ALDH1A1 (0.31) | ALDH1A1TSHR |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4675445-A | Process for elimination N-nitrosamines from N-nitrosamine-containing compositions | BASF CORPORATION (US) | 1987-06-23 | — | — | US | disclosed |